In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 23 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.33 | 10.99 | -8.03 | 0 | 3 | 0 | 33 | 302.377 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 11.46 | -36.52 | 1 | 3 | 1 | 34 | 303.385 | 5 | ↓ |